Vitas-M small molecule compound
(5E)-5-({2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)-3-(4-ethoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL419047
SMILES CCOc1ccc(cc1)N1C(=S)S/C(=C/c2cc(n(c2C)c2cccc(c2)C(F)(F)F)C)/C1=O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H21F3N2O2S2 MW 502.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21F3N2O2S2/c1-4-32-21-10-8-19(9-11-21)30-23(31)22(34-24(30)33)13-17-12-15(2)29(16(17)3)20-7-5-6-18(14-20)25(26,27)28/h5-14H,4H2,1-3H3/b22-13+InChIKey
YKTSVMOOLLKZQL-LPYMAVHISA-NSynonyms
(5E)5((25dimethyl1(3(trifluoromethyl)phenyl)1Hpyrrol3yl)methylidene)3(4ethoxyphenyl)2thioxo13thiazolidin4one
(5E)5((25DIMETHYL1(3(TRIFLUOROMETHYL)PHENYL)PYRROL3YL)METHYLIDENE)3(4ETHOXYPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC(=C4)C(F)(F)F)C)SC2=S
CCOc1ccc(cc1)N1C(=S)SC(=Cc2cc(n(c2C)c2cccc(c2)C(F)(F)F)C)C1=O
InChI=1SC25H21F3N2O2S2c14322110819(91121)3023(31)22(3424(30)33)13171215(2)29(16(17)3)2075618(1420)25(2627)28h514H4H213H3b2213+
MFCD04084352
ZINC000009310430
ZINC09310430
ZINC9310430
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